Crystallography Open Database

Information card for entry 2003768

2003767 << 2003768 >> 2003769

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Coordinates	2003768.cif
Original IUCr paper	HTML

Structure parameters

Formula	C12 H17 Cl N4 O3
Calculated formula	C12 H17 Cl N4 O3
Title of publication	2,3-Diamino-5-hydrophenazinium Chloride Trihydrate
Authors of publication	Brownstein, S. K.; Enright, G. D.
Journal of publication	Acta Crystallographica Section C
Year of publication	1995
Journal volume	51
Journal issue	8
Pages of publication	1579 - 1581
a	6.8102 ± 0.0014 Å
b	9.8841 ± 0.0018 Å
c	11.2926 ± 0.0018 Å
α	74.487 ± 0.016°
β	77.343 ± 0.015°
γ	83.58 ± 0.023°
Cell volume	713.5 ± 0.2 Å³
Cell temperature	278 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.06
Weighted residual factors for significantly intense reflections	0.07
Goodness-of-fit parameter for significantly intense reflections	2.3
Diffraction radiation wavelength	1.54056 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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